SCHEMBL1805563

SCHEMBL1805563

COC(=O)CNC(=O)c1ccc(C2=NCC(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)(C(F)(F)F)C2)cc1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC6A9 P48067 3/20 0.33
TACR1 P25103 2/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ESRRG P62508 1/20 0.32
PDE3B Q13370 2/20 0.32
PDE3A Q14432 2/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
EGLN1 Q9GZT9 2/20 0.32
VEGFA P15692 1/20 0.32
FLT1 P17948 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.32
CES2 O00748 1/20 0.31
MAPK1 P28482 1/20 0.31
RUVBL1 Q9Y265 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1807526 0.91 MAPT (0.34) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL1805189 0.91 EGLN1 (0.38) SLC6A9TACR1ESRRGEGLN1CES2
SCHEMBL1810061 0.85 CCR2 (0.35)
SCHEMBL3439106 0.82 EGLN1 (0.33) EGLN1EGLN3
SCHEMBL1805629 0.81 TRPV1 (0.33) PDE3BPDE3APOLBMAPTCES2
SCHEMBL12653604 0.80 EGLN1 (0.34) MEN1KMT2APOLBMAPTEGLN1
SCHEMBL13015189 0.79 RXRB (0.42) NPC1RAB9ASMN1; SMN2RUVBL1
SCHEMBL12653317 0.77 CCR2 (0.38)
SCHEMBL855479 0.77 NOTUM (0.37) TACR1NPC1RAB9ASMN1; SMN2PDE3B
SCHEMBL1814030 0.77 CCR2 (0.32) KMT2ANPC1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158560-B2 Insecticidal arylpyrroline compounds BAYER CROPSCIENCE AG (DE) 2012-04-17 US disclosed
US-8158560-B2 Insecticidal arylpyrroline compounds BAYER CROPSCIENCE AG (DE) 2012-04-17 US disclosed
US-8158560-B2 Insecticidal arylpyrroline compounds BAYER CROPSCIENCE AG (DE) 2012-04-17 US disclosed
US-20110118319-A1 Insecticidal Arylpyrroline Compounds BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
US-20110118319-A1 Insecticidal Arylpyrroline Compounds BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
US-20110118319-A1 Insecticidal Arylpyrroline Compounds BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
WO-2011054871-A1 INSECTICIDAL ARYLPYRROLINE COMPOUNDS BAYER CROPSCIENCE AG (DE) 2011-05-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110118319-A1 Insecticidal Arylpyrroline Compounds DDT, LAP3, CYP4X1 MEN1 3337/4885KMT2A 1020/4885SLC6A9 3360/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.